6,7-dimethoxy-N-(2-methoxy-5-methylphenyl)-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-N-(2-methoxy-5-methylphenyl)-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
6,7-dimethoxy-N-(2-methoxy-5-methylphenyl)-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C197-0092 |
| Compound Name: | 6,7-dimethoxy-N-(2-methoxy-5-methylphenyl)-2-methyl-3-[4-(methylsulfanyl)phenyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 506.62 |
| Molecular Formula: | C28 H30 N2 O5 S |
| Smiles: | Cc1ccc(c(c1)NC(C1C(c2ccc(cc2)SC)N(C)C(c2cc(c(cc12)OC)OC)=O)=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2675 |
| logD: | 4.2658 |
| logSw: | -4.3267 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.973 |
| InChI Key: | GRBJCMDYNIJDEG-UHFFFAOYSA-N |